SCHEMBL31066741

SCHEMBL31066741

OP(O)c1cccc(-c2ccccc2)c1P(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
BCL2L1 Q07817 1/20 0.41
CYP2A6 P11509 1/20 0.41
BACE1 P56817 1/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
HNF4A P41235 1/20 0.37
MAPK1 P28482 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
BCAT2 O15382 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
ALOX5 P09917 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15260401 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL30753793 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL3757327 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL2679731 0.79 ALDH1A1 (0.41) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL3861262 0.78 ALDH1A1 (0.44) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL10029671 0.72 CYP2A6 (0.52) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL12004263 0.71 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL2474597 0.71 MEN1 (0.33) ALDH1A1HSD17B10HPGDBCL2L1BACE1
SCHEMBL30662000 0.71 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6
SCHEMBL1768461 0.69 TDP1 (0.42) ALDH1A1HSD17B10HPGDBCL2L1CYP2A6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3929249-B1 LOW DIELECTRIC LOSS FACTOR POLYAMIDE MOLDING COMPOUND EMS CHEMIE AG (CH) 2024-10-09 EP disclosed